[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-propyl-azanium

Systemtic Name: [2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-propyl-azanium Openeye Name: [2-[(3-carbamoyl-2-thienyl)amino]-2-oxo-ethyl]-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-propyl-ammonium CAS Name: [2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl]-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-propylammonium IUPAC Name: [2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl]-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-propylazanium Traditional Name: [2-[(3-carbamoyl-2-thienyl)amino]-2-keto-ethyl]-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-propyl-ammonium Formula: C19H21ClN5O3S+ MolecularWeight: 434.91974

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(=O)NC3=C(C=CS3)C(=O)N

Isomeric SMILES

CCC[NH+](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)/p+1