(E)-N-[2,6-di(propan-2-yl)phenyl]-3-(4-phenyl-2H-thiochromen-3-yl)prop-2-enamide

Systemtic Name: (E)-N-[2,6-di(propan-2-yl)phenyl]-3-(4-phenyl-2H-thiochromen-3-yl)prop-2-enamide Openeye Name: (E)-N-(2,6-diisopropylphenyl)-3-(4-phenyl-2H-thiochromen-3-yl)prop-2-enamide CAS Name: (E)-N-[2,6-di(propan-2-yl)phenyl]-3-(4-phenyl-2H-1-benzothiopyran-3-yl)-2-propenamide IUPAC Name: (E)-N-[2,6-di(propan-2-yl)phenyl]-3-(4-phenyl-2H-thiochromen-3-yl)prop-2-enamide Traditional Name: (E)-N-(2,6-diisopropylphenyl)-3-(4-phenyl-2H-thiochromen-3-yl)acrylamide Formula: C30H31NOS MolecularWeight: 453.63824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C=CC2=C(C3=CC=CC=C3SC2)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)/C=C/C2=C(C3=CC=CC=C3SC2)C4=CC=CC=C4

InChI

InChI=1S/C30H31NOS/c1-20(2)24-14-10-15-25(21(3)4)30(24)31-28(32)18-17-23-19-33-27-16-9-8-13-26(27)29(23)22-11-6-5-7-12-22/h5-18,20-21H,19H2,1-4H3,(H,31,32)/b18-17+