N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]-4-[methylsulfonyl(prop-2-enyl)amino]benzamide

Systemtic Name: N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]-4-[methylsulfonyl(prop-2-enyl)amino]benzamide Openeye Name: 4-[allyl(methylsulfonyl)amino]-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzamide CAS Name: N-[2-methyl-4-[(phenylthio)methyl]phenyl]-4-[methylsulfonyl(prop-2-enyl)amino]benzamide IUPAC Name: N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]-4-[methylsulfonyl(prop-2-enyl)amino]benzamide Traditional Name: 4-[allyl(mesyl)amino]-N-[2-methyl-4-[(phenylthio)methyl]phenyl]benzamide Formula: C25H26N2O3S2 MolecularWeight: 466.61554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)N(CC=C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)N(CC=C)S(=O)(=O)C

InChI

InChI=1S/C25H26N2O3S2/c1-4-16-27(32(3,29)30)22-13-11-21(12-14-22)25(28)26-24-15-10-20(17-19(24)2)18-31-23-8-6-5-7-9-23/h4-15,17H,1,16,18H2,2-3H3,(H,26,28)