cyclopropyl-[2-[(3-ethoxycarbonyl-4-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-propan-2-yl-azanium

Systemtic Name: cyclopropyl-[2-[(3-ethoxycarbonyl-4-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-propan-2-yl-azanium Openeye Name: cyclopropyl-[2-[(3-ethoxycarbonyl-4-phenyl-2-thienyl)amino]-2-oxo-ethyl]-isopropyl-ammonium CAS Name: cyclopropyl-[2-[(3-ethoxycarbonyl-4-phenyl-2-thiophenyl)amino]-2-oxoethyl]-propan-2-ylammonium IUPAC Name: cyclopropyl-[2-[(3-ethoxycarbonyl-4-phenylthiophen-2-yl)amino]-2-oxoethyl]-propan-2-ylazanium Traditional Name: [2-[(3-carbethoxy-4-phenyl-2-thienyl)amino]-2-keto-ethyl]-cyclopropyl-isopropyl-ammonium Formula: C21H27N2O3S+ MolecularWeight: 387.51568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C[NH+](C3CC3)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C[NH+](C3CC3)C(C)C

InChI

InChI=1S/C21H26N2O3S/c1-4-26-21(25)19-17(15-8-6-5-7-9-15)13-27-20(19)22-18(24)12-23(14(2)3)16-10-11-16/h5-9,13-14,16H,4,10-12H2,1-3H3,(H,22,24)/p+1