2-[2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-propyl-amino]ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-propyl-amino]ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-propyl-amino]acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-propylamino]-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-propylamino]acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl-propyl-amino]acetyl]amino]thiophene-3-carboxamide Formula: C19H20ClN5O3S MolecularWeight: 433.9118

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(=O)NC3=C(C=CS3)C(=O)N

Isomeric SMILES

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(=O)NC3=C(C=CS3)C(=O)N

InChI

InChI=1S/C19H20ClN5O3S/c1-2-6-25(10-16(26)24-19-13(17(21)27)5-7-29-19)9-15-22-14-8-11(20)3-4-12(14)18(28)23-15/h3-5,7-8H,2,6,9-10H2,1H3,(H2,21,27)(H,24,26)(H,22,23,28)