2-[[3-(4-chlorophenyl)-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[[4-(diethylamino)phenyl]methylideneamino]ethanamide

Systemtic Name: 2-[[3-(4-chlorophenyl)-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[[4-(diethylamino)phenyl]methylideneamino]ethanamide Openeye Name: 2-[[3-(4-chlorophenyl)-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[[4-(diethylamino)phenyl]methyleneamino]acetamide CAS Name: 2-[[3-(4-chlorophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]thio]-N-[[4-(diethylamino)phenyl]methylideneamino]acetamide IUPAC Name: 2-[[3-(4-chlorophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[[4-(diethylamino)phenyl]methylideneamino]acetamide Traditional Name: 2-[[3-(4-chlorophenyl)-4-keto-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl]thio]-N-[[4-(diethylamino)benzylidene]amino]acetamide Formula: C29H30ClN5O2S2 MolecularWeight: 580.1638

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=NNC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=C(C=C5)Cl

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C=NNC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=C(C=C5)Cl

InChI

InChI=1S/C29H30ClN5O2S2/c1-3-34(4-2)21-13-9-19(10-14-21)17-31-33-25(36)18-38-29-32-27-26(23-7-5-6-8-24(23)39-27)28(37)35(29)22-15-11-20(30)12-16-22/h9-17H,3-8,18H2,1-2H3,(H,33,36)