methyl 2-[2-[ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-[ethyl-[(4-keto-1H-quinazolin-2-yl)methyl]amino]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC3=C(C(=C(S3)C)C)C(=O)OC

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC3=C(C(=C(S3)C)C)C(=O)OC

InChI

InChI=1S/C21H24N4O4S/c1-5-25(10-16-22-15-9-7-6-8-14(15)19(27)23-16)11-17(26)24-20-18(21(28)29-4)12(2)13(3)30-20/h6-9H,5,10-11H2,1-4H3,(H,24,26)(H,22,23,27)