4-azanyl-N-[4-[(3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-3-nitro-benzamide

Systemtic Name: 4-azanyl-N-[4-[(3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-3-nitro-benzamide Openeye Name: 4-amino-N-[4-[(3-methyl-1-piperidyl)methyl]thiazol-2-yl]-3-nitro-benzamide CAS Name: 4-amino-N-[4-[(3-methyl-1-piperidinyl)methyl]-2-thiazolyl]-3-nitrobenzamide IUPAC Name: 4-amino-N-[4-[(3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-3-nitrobenzamide Traditional Name: 4-amino-N-[4-[(3-methylpiperidino)methyl]thiazol-2-yl]-3-nitro-benzamide Formula: C17H21N5O3S MolecularWeight: 375.44534

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)CC2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O3S/c1-11-3-2-6-21(8-11)9-13-10-26-17(19-13)20-16(23)12-4-5-14(18)15(7-12)22(24)25/h4-5,7,10-11H,2-3,6,8-9,18H2,1H3,(H,19,20,23)