4-[[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]amino]-3-nitro-benzamide

Systemtic Name: 4-[[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]amino]-3-nitro-benzamide Openeye Name: 4-[[(R)-(4-ethylphenyl)-(2-thienyl)methyl]amino]-3-nitro-benzamide CAS Name: 4-[[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]amino]-3-nitrobenzamide IUPAC Name: 4-[[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]amino]-3-nitrobenzamide Traditional Name: 4-[[(R)-(4-ethylphenyl)-(2-thienyl)methyl]amino]-3-nitro-benzamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C2=CC=CS2)NC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O3S/c1-2-13-5-7-14(8-6-13)19(18-4-3-11-27-18)22-16-10-9-15(20(21)24)12-17(16)23(25)26/h3-12,19,22H,2H2,1H3,(H2,21,24)/t19-/m1/s1