1-cyclohexyl-3-(12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea

Systemtic Name: 1-cyclohexyl-3-(12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea Openeye Name: 1-cyclohexyl-3-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea CAS Name: 1-cyclohexyl-3-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea IUPAC Name: 1-cyclohexyl-3-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea Traditional Name: 1-cyclohexyl-3-(12-keto-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea Formula: C20H26N4OS MolecularWeight: 370.51164

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC2=CC3=C(C=C2)N=C4CCCCCN4C3=O

Isomeric SMILES

C1CCC(CC1)NC(=S)NC2=CC3=C(C=C2)N=C4CCCCCN4C3=O

InChI

InChI=1S/C20H26N4OS/c25-19-16-13-15(22-20(26)21-14-7-3-1-4-8-14)10-11-17(16)23-18-9-5-2-6-12-24(18)19/h10-11,13-14H,1-9,12H2,(H2,21,22,26)