N-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-6-phenyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-6-phenyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-6-phenyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-6-phenyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-6-phenylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-(6-phenylthieno[2,3-d]pyrimidin-4-yl)amine Formula: C21H16N4O2S MolecularWeight: 388.44234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C2C=C(SC2=NC=N1)C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C/C(=N/NC1=C2C=C(SC2=NC=N1)C3=CC=CC=C3)/C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H16N4O2S/c1-13(15-7-8-17-18(9-15)27-12-26-17)24-25-20-16-10-19(14-5-3-2-4-6-14)28-21(16)23-11-22-20/h2-11H,12H2,1H3,(H,22,23,25)/b24-13-