2-[2-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]propanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]propanoylamino]thiophene-3-carboxamide Openeye Name: 2-[2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]propanoylamino]thiophene-3-carboxamide CAS Name: 2-[[2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]propanoylamino]thiophene-3-carboxamide Traditional Name: 2-[2-[(4-keto-1H-quinazolin-2-yl)methyl-methyl-amino]propanoylamino]thiophene-3-carboxamide Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C(=O)N)N(C)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC(C(=O)NC1=C(C=CS1)C(=O)N)N(C)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C18H19N5O3S/c1-10(16(25)22-18-12(15(19)24)7-8-27-18)23(2)9-14-20-13-6-4-3-5-11(13)17(26)21-14/h3-8,10H,9H2,1-2H3,(H2,19,24)(H,22,25)(H,20,21,26)