(7-methoxy-2,2-dimethyl-thiochromen-4-yl)-[1-(phenylmethyl)pyrrol-2-yl]methanol

Systemtic Name: (7-methoxy-2,2-dimethyl-thiochromen-4-yl)-[1-(phenylmethyl)pyrrol-2-yl]methanol Openeye Name: (1-benzylpyrrol-2-yl)-(7-methoxy-2,2-dimethyl-thiochromen-4-yl)methanol CAS Name: (7-methoxy-2,2-dimethyl-1-benzothiopyran-4-yl)-[1-(phenylmethyl)-2-pyrrolyl]methanol IUPAC Name: (1-benzylpyrrol-2-yl)-(7-methoxy-2,2-dimethylthiochromen-4-yl)methanol Traditional Name: (1-benzylpyrrol-2-yl)-(7-methoxy-2,2-dimethyl-thiochromen-4-yl)methanol Formula: C24H25NO2S MolecularWeight: 391.5258

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C2=C(S1)C=C(C=C2)OC)C(C3=CC=CN3CC4=CC=CC=C4)O)C

Isomeric SMILES

CC1(C=C(C2=C(S1)C=C(C=C2)OC)C(C3=CC=CN3CC4=CC=CC=C4)O)C

InChI

InChI=1S/C24H25NO2S/c1-24(2)15-20(19-12-11-18(27-3)14-22(19)28-24)23(26)21-10-7-13-25(21)16-17-8-5-4-6-9-17/h4-15,23,26H,16H2,1-3H3