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

Systemtic Name: 1-cyclopropyl-3-(12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea Openeye Name: 1-cyclopropyl-3-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea CAS Name: 1-cyclopropyl-3-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea IUPAC Name: 1-cyclopropyl-3-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea Traditional Name: 1-cyclopropyl-3-(12-keto-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea Formula: C17H20N4OS MolecularWeight: 328.4319

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=C(C=C(C=C3)NC(=S)NC4CC4)C(=O)N2CC1

Isomeric SMILES

C1CCC2=NC3=C(C=C(C=C3)NC(=S)NC4CC4)C(=O)N2CC1

InChI

InChI=1S/C17H20N4OS/c22-16-13-10-12(19-17(23)18-11-5-6-11)7-8-14(13)20-15-4-2-1-3-9-21(15)16/h7-8,10-11H,1-6,9H2,(H2,18,19,23)