1-prop-2-enyl-3-(7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-12-ylidene)thiourea

Systemtic Name: 1-prop-2-enyl-3-(7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-12-ylidene)thiourea Openeye Name: 1-allyl-3-(7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-12-ylidene)thiourea CAS Name: 1-prop-2-enyl-3-(7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-12-ylidene)thiourea IUPAC Name: 1-prop-2-enyl-3-(7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-12-ylidene)thiourea Traditional Name: 1-allyl-3-(7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-12-ylidene)thiourea Formula: C17H20N4S MolecularWeight: 312.4325

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)N=C1C2=CC=CC=C2N=C3N1CCCCC3

Isomeric SMILES

C=CCNC(=S)N=C1C2=CC=CC=C2N=C3N1CCCCC3

InChI

InChI=1S/C17H20N4S/c1-2-11-18-17(22)20-16-13-8-5-6-9-14(13)19-15-10-4-3-7-12-21(15)16/h2,5-6,8-9H,1,3-4,7,10-12H2,(H,18,22)