3-(4-chlorophenyl)-1-(2-dimethylaminoethyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiourea

Systemtic Name: 3-(4-chlorophenyl)-1-(2-dimethylaminoethyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiourea Openeye Name: 3-(4-chlorophenyl)-1-(2-dimethylaminoethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea CAS Name: 3-(4-chlorophenyl)-1-(2-dimethylaminoethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea IUPAC Name: 3-(4-chlorophenyl)-1-(2-dimethylaminoethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea Traditional Name: 3-(4-chlorophenyl)-1-(2-dimethylaminoethyl)-1-[(4-keto-1H-quinazolin-2-yl)methyl]thiourea Formula: C20H22ClN5OS MolecularWeight: 415.93958

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C)CCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H22ClN5OS/c1-25(2)11-12-26(20(28)22-15-9-7-14(21)8-10-15)13-18-23-17-6-4-3-5-16(17)19(27)24-18/h3-10H,11-13H2,1-2H3,(H,22,28)(H,23,24,27)