1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-3-phenethyl-1-(phenylmethyl)thiourea

Systemtic Name: 1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-3-phenethyl-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-3-phenethyl-thiourea CAS Name: 1-[(4-oxo-1H-quinazolin-2-yl)methyl]-3-phenethyl-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-3-phenethylthiourea Traditional Name: 1-benzyl-1-[(4-keto-1H-quinazolin-2-yl)methyl]-3-phenethyl-thiourea Formula: C25H24N4OS MolecularWeight: 428.54926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C25H24N4OS/c30-24-21-13-7-8-14-22(21)27-23(28-24)18-29(17-20-11-5-2-6-12-20)25(31)26-16-15-19-9-3-1-4-10-19/h1-14H,15-18H2,(H,26,31)(H,27,28,30)