N-[2-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylindol-1-yl]ethyl]-4-ethoxy-benzamide

Systemtic Name: N-[2-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylindol-1-yl]ethyl]-4-ethoxy-benzamide Openeye Name: N-[2-[3-(2-amino-2-oxo-ethyl)sulfanylindol-1-yl]ethyl]-4-ethoxy-benzamide CAS Name: N-[2-[3-[(2-amino-2-oxoethyl)thio]-1-indolyl]ethyl]-4-ethoxybenzamide IUPAC Name: N-[2-[3-(2-amino-2-oxoethyl)sulfanylindol-1-yl]ethyl]-4-ethoxybenzamide Traditional Name: N-[2-[3-[(2-amino-2-keto-ethyl)thio]indol-1-yl]ethyl]-4-ethoxy-benzamide Formula: C21H23N3O3S MolecularWeight: 397.49062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC(=O)N

InChI

InChI=1S/C21H23N3O3S/c1-2-27-16-9-7-15(8-10-16)21(26)23-11-12-24-13-19(28-14-20(22)25)17-5-3-4-6-18(17)24/h3-10,13H,2,11-12,14H2,1H3,(H2,22,25)(H,23,26)