3-(3-chloranyl-4-methyl-phenyl)-1-(2-methoxyethyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiourea

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-1-(2-methoxyethyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiourea Openeye Name: 3-(3-chloro-4-methyl-phenyl)-1-(2-methoxyethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea CAS Name: 3-(3-chloro-4-methylphenyl)-1-(2-methoxyethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea IUPAC Name: 3-(3-chloro-4-methylphenyl)-1-(2-methoxyethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea Traditional Name: 3-(3-chloro-4-methyl-phenyl)-1-[(4-keto-1H-quinazolin-2-yl)methyl]-1-(2-methoxyethyl)thiourea Formula: C20H21ClN4O2S MolecularWeight: 416.92434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N(CCOC)CC2=NC(=O)C3=CC=CC=C3N2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N(CCOC)CC2=NC(=O)C3=CC=CC=C3N2)Cl

InChI

InChI=1S/C20H21ClN4O2S/c1-13-7-8-14(11-16(13)21)22-20(28)25(9-10-27-2)12-18-23-17-6-4-3-5-15(17)19(26)24-18/h3-8,11H,9-10,12H2,1-2H3,(H,22,28)(H,23,24,26)