3-[(3-chloranyl-2-methyl-phenyl)amino]-4-(furan-2-ylmethylsulfanyl)-1-(phenylmethyl)pyrrole-2,5-dione

Systemtic Name: 3-[(3-chloranyl-2-methyl-phenyl)amino]-4-(furan-2-ylmethylsulfanyl)-1-(phenylmethyl)pyrrole-2,5-dione Openeye Name: 1-benzyl-3-(3-chloro-2-methyl-anilino)-4-(2-furylmethylsulfanyl)pyrrole-2,5-dione CAS Name: 3-(3-chloro-2-methylanilino)-4-(2-furanylmethylthio)-1-(phenylmethyl)pyrrole-2,5-dione IUPAC Name: 1-benzyl-3-(3-chloro-2-methylanilino)-4-(furan-2-ylmethylsulfanyl)pyrrole-2,5-dione Traditional Name: 1-benzyl-3-(3-chloro-2-methyl-anilino)-4-(2-furfurylthio)-3-pyrroline-2,5-quinone Formula: C23H19ClN2O3S MolecularWeight: 438.92656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SCC4=CC=CO4

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SCC4=CC=CO4

InChI

InChI=1S/C23H19ClN2O3S/c1-15-18(24)10-5-11-19(15)25-20-21(30-14-17-9-6-12-29-17)23(28)26(22(20)27)13-16-7-3-2-4-8-16/h2-12,25H,13-14H2,1H3