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

Systemtic Name: 1-(12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)-3-propan-2-yl-thiourea Openeye Name: 1-isopropyl-3-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea CAS Name: 1-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)-3-propan-2-ylthiourea IUPAC Name: 1-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)-3-propan-2-ylthiourea Traditional Name: 1-isopropyl-3-(12-keto-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NC1=CC2=C(C=C1)N=C3CCCCCN3C2=O

Isomeric SMILES

CC(C)NC(=S)NC1=CC2=C(C=C1)N=C3CCCCCN3C2=O

InChI

InChI=1S/C17H22N4OS/c1-11(2)18-17(23)19-12-7-8-14-13(10-12)16(22)21-9-5-3-4-6-15(21)20-14/h7-8,10-11H,3-6,9H2,1-2H3,(H2,18,19,23)