3-[5-(4-chlorophenyl)furan-2-yl]-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]prop-2-enamide

Systemtic Name: 3-[5-(4-chlorophenyl)furan-2-yl]-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]prop-2-enamide Openeye Name: 3-[5-(4-chlorophenyl)-2-furyl]-N-[[2-(1-naphthyl)benzotriazol-5-yl]carbamothioyl]prop-2-enamide CAS Name: 3-[5-(4-chlorophenyl)-2-furanyl]-N-[[[2-(1-naphthalenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: 3-[5-(4-chlorophenyl)furan-2-yl]-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]prop-2-enamide Traditional Name: 3-[5-(4-chlorophenyl)-2-furyl]-N-[[2-(1-naphthyl)benzotriazol-5-yl]thiocarbamoyl]acrylamide Formula: C30H20ClN5O2S MolecularWeight: 550.0301

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2N3N=C4C=CC(=CC4=N3)NC(=S)NC(=O)C=CC5=CC=C(O5)C6=CC=C(C=C6)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2N3N=C4C=CC(=CC4=N3)NC(=S)NC(=O)C=CC5=CC=C(O5)C6=CC=C(C=C6)Cl

InChI

InChI=1S/C30H20ClN5O2S/c31-21-10-8-20(9-11-21)28-16-13-23(38-28)14-17-29(37)33-30(39)32-22-12-15-25-26(18-22)35-36(34-25)27-7-3-5-19-4-1-2-6-24(19)27/h1-18H,(H2,32,33,37,39)