(5-chloranylthiophen-2-yl)methyl-[2-[(2-methyl-6-propan-2-yl-phenyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[2-[(2-methyl-6-propan-2-yl-phenyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-azanium Openeye Name: allyl-[(5-chloro-2-thienyl)methyl]-[2-(2-isopropyl-6-methyl-anilino)-2-oxo-ethyl]ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]-prop-2-enylammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]-prop-2-enylazanium Traditional Name: allyl-[(5-chloro-2-thienyl)methyl]-[2-(2-isopropyl-6-methyl-anilino)-2-keto-ethyl]ammonium Formula: C20H26ClN2OS+ MolecularWeight: 377.95124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)C[NH+](CC=C)CC2=CC=C(S2)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)C[NH+](CC=C)CC2=CC=C(S2)Cl

InChI

InChI=1S/C20H25ClN2OS/c1-5-11-23(12-16-9-10-18(21)25-16)13-19(24)22-20-15(4)7-6-8-17(20)14(2)3/h5-10,14H,1,11-13H2,2-4H3,(H,22,24)/p+1