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

Systemtic Name: 2-[(E,3Z)-3-(3H-1,3-benzothiazol-2-ylidene)prop-1-enyl]-3,4-diethyl-1,3-benzothiazol-3-ium Openeye Name: 2-[(E,3Z)-3-(3H-1,3-benzothiazol-2-ylidene)prop-1-enyl]-3,4-diethyl-1,3-benzothiazol-3-ium CAS Name: 2-[(E,3Z)-3-(3H-1,3-benzothiazol-2-ylidene)prop-1-enyl]-3,4-diethyl-1,3-benzothiazol-3-ium IUPAC Name: 2-[(E,3Z)-3-(3H-1,3-benzothiazol-2-ylidene)prop-1-enyl]-3,4-diethyl-1,3-benzothiazol-3-ium Traditional Name: 2-[(E,3Z)-3-(3H-1,3-benzothiazol-2-ylidene)prop-1-enyl]-3,4-diethyl-1,3-benzothiazol-3-ium Formula: C21H21N2S2+ MolecularWeight: 365.53484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2S2/c1-3-15-9-7-12-18-21(15)23(4-2)20(25-18)14-8-13-19-22-16-10-5-6-11-17(16)24-19/h5-14H,3-4H2,1-2H3/p+1