3-prop-2-enyl-2-[(E,3Z)-3-(1,3,3-trimethylindol-2-ylidene)prop-1-enyl]-1,3-benzothiazol-3-ium

Systemtic Name: 3-prop-2-enyl-2-[(E,3Z)-3-(1,3,3-trimethylindol-2-ylidene)prop-1-enyl]-1,3-benzothiazol-3-ium Openeye Name: 3-allyl-2-[(E,3Z)-3-(1,3,3-trimethylindolin-2-ylidene)prop-1-enyl]-1,3-benzothiazol-3-ium CAS Name: 3-prop-2-enyl-2-[(E,3Z)-3-(1,3,3-trimethyl-2-indolylidene)prop-1-enyl]-1,3-benzothiazol-3-ium IUPAC Name: 3-prop-2-enyl-2-[(E,3Z)-3-(1,3,3-trimethylindol-2-ylidene)prop-1-enyl]-1,3-benzothiazol-3-ium Traditional Name: 3-allyl-2-[(E,3Z)-3-(1,3,3-trimethylindolin-2-ylidene)prop-1-enyl]-1,3-benzothiazol-3-ium Formula: C24H25N2S+ MolecularWeight: 373.5337

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC=CC3=[N+](C4=CC=CC=C4S3)CC=C)C)C

Isomeric SMILES

CC\1(C2=CC=CC=C2N(/C1=C\C=C\C3=[N+](C4=CC=CC=C4S3)CC=C)C)C

InChI

InChI=1S/C24H25N2S/c1-5-17-26-20-13-8-9-14-21(20)27-23(26)16-10-15-22-24(2,3)18-11-6-7-12-19(18)25(22)4/h5-16H,1,17H2,2-4H3/q+1