2-(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)-1-(4-phenoxyphenyl)guanidine

Systemtic Name: 2-(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)-1-(4-phenoxyphenyl)guanidine Openeye Name: 2-(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)-1-(4-phenoxyphenyl)guanidine CAS Name: 2-(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)-1-(4-phenoxyphenyl)guanidine IUPAC Name: 2-(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)-1-(4-phenoxyphenyl)guanidine Traditional Name: 2-(4-keto-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)-1-(4-phenoxyphenyl)guanidine Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)N=C(N2)N=C(N)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=O)N=C(N2)/N=C(/N)\NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C21H21N5O2/c22-20(26-21-24-18-9-5-4-8-17(18)19(27)25-21)23-14-10-12-16(13-11-14)28-15-6-2-1-3-7-15/h1-3,6-7,10-13H,4-5,8-9H2,(H4,22,23,24,25,26,27)