1-[(1S,2S)-2-methylcyclohexyl]-3-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)thiourea

Systemtic Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)thiourea Openeye Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(2-morpholino-1,3-benzothiazol-6-yl)thiourea CAS Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]thiourea IUPAC Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)thiourea Traditional Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(2-morpholino-1,3-benzothiazol-6-yl)thiourea Formula: C19H26N4OS2 MolecularWeight: 390.56594

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4

InChI

InChI=1S/C19H26N4OS2/c1-13-4-2-3-5-15(13)21-18(25)20-14-6-7-16-17(12-14)26-19(22-16)23-8-10-24-11-9-23/h6-7,12-13,15H,2-5,8-11H2,1H3,(H2,20,21,25)/t13-,15-/m0/s1