N-[4-[bis(azanyl)methylideneamino]sulfonylphenyl]-3-(2,4-diphenyl-6-propan-2-yl-pyridin-1-ium-1-yl)propanamide

Systemtic Name: N-[4-[bis(azanyl)methylideneamino]sulfonylphenyl]-3-(2,4-diphenyl-6-propan-2-yl-pyridin-1-ium-1-yl)propanamide Openeye Name: N-(4-guanidinosulfonylphenyl)-3-(2-isopropyl-4,6-diphenyl-pyridin-1-ium-1-yl)propanamide CAS Name: N-[4-(diaminomethylideneamino)sulfonylphenyl]-3-(2,4-diphenyl-6-propan-2-yl-1-pyridin-1-iumyl)propanamide IUPAC Name: N-[4-(diaminomethylideneamino)sulfonylphenyl]-3-(2,4-diphenyl-6-propan-2-ylpyridin-1-ium-1-yl)propanamide Traditional Name: N-(4-guanidinosulfonylphenyl)-3-(2-isopropyl-4,6-diphenyl-pyridin-1-ium-1-yl)propionamide Formula: C30H32N5O3S+ MolecularWeight: 542.67178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=[N+]1CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC(=CC(=[N+]1CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H31N5O3S/c1-21(2)27-19-24(22-9-5-3-6-10-22)20-28(23-11-7-4-8-12-23)35(27)18-17-29(36)33-25-13-15-26(16-14-25)39(37,38)34-30(31)32/h3-16,19-21H,17-18H2,1-2H3,(H4-,31,32,33,34,36)/p+1