2-[(E,3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-2-methyl-prop-1-enyl]-3,4-diethyl-1,3-benzothiazol-3-ium

Systemtic Name: 2-[(E,3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-2-methyl-prop-1-enyl]-3,4-diethyl-1,3-benzothiazol-3-ium Openeye Name: 2-[(E,3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-2-methyl-prop-1-enyl]-3,4-diethyl-1,3-benzothiazol-3-ium CAS Name: 2-[(E,3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-2-methylprop-1-enyl]-3,4-diethyl-1,3-benzothiazol-3-ium IUPAC Name: 2-[(E,3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-2-methylprop-1-enyl]-3,4-diethyl-1,3-benzothiazol-3-ium Traditional Name: 2-[(E,3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-2-methyl-prop-1-enyl]-3,4-diethyl-1,3-benzothiazol-3-ium Formula: C22H23N2S2+ MolecularWeight: 379.56142

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=[N+]2CC)C=C(C)C=C3NC4=CC=CC=C4S3

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=[N+]2CC)/C=C(\C)/C=C\3/NC4=CC=CC=C4S3

InChI

InChI=1S/C22H22N2S2/c1-4-16-9-8-12-19-22(16)24(5-2)21(26-19)14-15(3)13-20-23-17-10-6-7-11-18(17)25-20/h6-14H,4-5H2,1-3H3/p+1