N-(2-dimethylaminoethyl)-2-[(3-nitrophenyl)carbonylamino]-1,3-thiazole-4-carboxamide hydrochloride

Systemtic Name: N-(2-dimethylaminoethyl)-2-[(3-nitrophenyl)carbonylamino]-1,3-thiazole-4-carboxamide hydrochloride Openeye Name: N-(2-dimethylaminoethyl)-2-[(3-nitrobenzoyl)amino]thiazole-4-carboxamide hydrochloride CAS Name: N-(2-dimethylaminoethyl)-2-[[(3-nitrophenyl)-oxomethyl]amino]-4-thiazolecarboxamide hydrochloride IUPAC Name: N-(2-dimethylaminoethyl)-2-[(3-nitrobenzoyl)amino]-1,3-thiazole-4-carboxamide hydrochloride Traditional Name: N-(2-dimethylaminoethyl)-2-[(3-nitrobenzoyl)amino]thiazole-4-carboxamide hydrochloride Formula: C15H18ClN5O4S MolecularWeight: 399.85252

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CSC(=N1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-].Cl

Isomeric SMILES

CN(C)CCNC(=O)C1=CSC(=N1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C15H17N5O4S.ClH/c1-19(2)7-6-16-14(22)12-9-25-15(17-12)18-13(21)10-4-3-5-11(8-10)20(23)24;/h3-5,8-9H,6-7H2,1-2H3,(H,16,22)(H,17,18,21);1H