N-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide

Systemtic Name: N-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]-3-(8-methyl-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-3-(8-methyl-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]-3-(4-keto-8-methyl-quinazolin-3-yl)propionamide Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NCC(=O)NC3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NCC(=O)NC3=C(C(=CC=C3)Cl)C

InChI

InChI=1S/C21H21ClN4O3/c1-13-5-3-6-15-20(13)24-12-26(21(15)29)10-9-18(27)23-11-19(28)25-17-8-4-7-16(22)14(17)2/h3-8,12H,9-11H2,1-2H3,(H,23,27)(H,25,28)