1-[(7-chloranyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)-phenyl-methyl]-1-(4-methylphenyl)-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(7-chloranyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)-phenyl-methyl]-1-(4-methylphenyl)-3-prop-2-enyl-thiourea Openeye Name: 3-allyl-1-[(7-chloro-3-ethyl-4-oxo-quinazolin-2-yl)-phenyl-methyl]-1-(p-tolyl)thiourea CAS Name: 1-[(7-chloro-3-ethyl-4-oxo-2-quinazolinyl)-phenylmethyl]-1-(4-methylphenyl)-3-prop-2-enylthiourea IUPAC Name: 1-[(7-chloro-3-ethyl-4-oxoquinazolin-2-yl)-phenylmethyl]-1-(4-methylphenyl)-3-prop-2-enylthiourea Traditional Name: 3-allyl-1-[(7-chloro-3-ethyl-4-keto-quinazolin-2-yl)-phenyl-methyl]-1-(p-tolyl)thiourea Formula: C28H27ClN4OS MolecularWeight: 503.05818

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1C(C3=CC=CC=C3)N(C4=CC=C(C=C4)C)C(=S)NCC=C

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1C(C3=CC=CC=C3)N(C4=CC=C(C=C4)C)C(=S)NCC=C

InChI

InChI=1S/C28H27ClN4OS/c1-4-17-30-28(35)33(22-14-11-19(3)12-15-22)25(20-9-7-6-8-10-20)26-31-24-18-21(29)13-16-23(24)27(34)32(26)5-2/h4,6-16,18,25H,1,5,17H2,2-3H3,(H,30,35)