[ethylsulfanyl-[2-(5-methoxy-1H-indol-3-yl)ethylamino]methylidene]-(phenylmethyl)azanium

Systemtic Name: [ethylsulfanyl-[2-(5-methoxy-1H-indol-3-yl)ethylamino]methylidene]-(phenylmethyl)azanium Openeye Name: benzyl-[ethylsulfanyl-[2-(5-methoxy-1H-indol-3-yl)ethylamino]methylene]ammonium CAS Name: [(ethylthio)-[2-(5-methoxy-1H-indol-3-yl)ethylamino]methylidene]-(phenylmethyl)ammonium IUPAC Name: benzyl-[ethylsulfanyl-[2-(5-methoxy-1H-indol-3-yl)ethylamino]methylidene]azanium Traditional Name: benzyl-[(ethylthio)-[2-(5-methoxy-1H-indol-3-yl)ethylamino]methylene]ammonium Formula: C21H26N3OS+ MolecularWeight: 368.51564

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=[NH+]CC1=CC=CC=C1)NCCC2=CNC3=C2C=C(C=C3)OC

Isomeric SMILES

CCSC(=[NH+]CC1=CC=CC=C1)NCCC2=CNC3=C2C=C(C=C3)OC

InChI

InChI=1S/C21H25N3OS/c1-3-26-21(24-14-16-7-5-4-6-8-16)22-12-11-17-15-23-20-10-9-18(25-2)13-19(17)20/h4-10,13,15,23H,3,11-12,14H2,1-2H3,(H,22,24)/p+1