phenyl-[(1-prop-2-enyl-4,5-dihydrobenzo[e][1,3]benzothiazol-2-ylidene)carbamoylamino]azanium

Systemtic Name: phenyl-[(1-prop-2-enyl-4,5-dihydrobenzo[e][1,3]benzothiazol-2-ylidene)carbamoylamino]azanium Openeye Name: [(1-allyl-4,5-dihydrobenzo[e][1,3]benzothiazol-2-ylidene)carbamoylamino]-phenyl-ammonium CAS Name: [[oxo-[(1-prop-2-enyl-4,5-dihydrobenzo[e][1,3]benzothiazol-2-ylidene)amino]methyl]amino]-phenylammonium IUPAC Name: phenyl-[(1-prop-2-enyl-4,5-dihydrobenzo[e][1,3]benzothiazol-2-ylidene)carbamoylamino]azanium Traditional Name: [(1-allyl-4,5-dihydrobenzo[e][1,3]benzothiazol-2-ylidene)carbamoylamino]-phenyl-ammonium Formula: C21H21N4OS+ MolecularWeight: 377.48264

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(CCC3=CC=CC=C32)SC1=NC(=O)N[NH2+]C4=CC=CC=C4

Isomeric SMILES

C=CCN1C2=C(CCC3=CC=CC=C32)SC1=NC(=O)N[NH2+]C4=CC=CC=C4

InChI

InChI=1S/C21H20N4OS/c1-2-14-25-19-17-11-7-6-8-15(17)12-13-18(19)27-21(25)22-20(26)24-23-16-9-4-3-5-10-16/h2-11,23H,1,12-14H2,(H,24,26)/p+1