4-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-3-nitro-benzenecarbonitrile Openeye Name: 4-[methyl-[(3-methyl-2-thienyl)methyl]amino]-3-nitro-benzonitrile CAS Name: 4-[methyl-[(3-methyl-2-thiophenyl)methyl]amino]-3-nitrobenzonitrile IUPAC Name: 4-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-3-nitrobenzonitrile Traditional Name: 4-[methyl-[(3-methyl-2-thienyl)methyl]amino]-3-nitro-benzonitrile Formula: C14H13N3O2S MolecularWeight: 287.33692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(C)C2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC=C1)CN(C)C2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O2S/c1-10-5-6-20-14(10)9-16(2)12-4-3-11(8-15)7-13(12)17(18)19/h3-7H,9H2,1-2H3