1-[(E)-[(2Z)-4-chloranyl-3-prop-2-enyl-2-thiophen-2-ylsulfonylimino-1,3-thiazol-5-yl]methylideneamino]-3-methyl-thiourea

Systemtic Name: 1-[(E)-[(2Z)-4-chloranyl-3-prop-2-enyl-2-thiophen-2-ylsulfonylimino-1,3-thiazol-5-yl]methylideneamino]-3-methyl-thiourea Openeye Name: 1-[(E)-[(2Z)-3-allyl-4-chloro-2-(2-thienylsulfonylimino)thiazol-5-yl]methyleneamino]-3-methyl-thiourea CAS Name: 1-[(E)-[(2Z)-4-chloro-3-prop-2-enyl-2-thiophen-2-ylsulfonylimino-5-thiazolyl]methylideneamino]-3-methylthiourea IUPAC Name: 1-[(E)-[(2Z)-4-chloro-3-prop-2-enyl-2-thiophen-2-ylsulfonylimino-1,3-thiazol-5-yl]methylideneamino]-3-methylthiourea Traditional Name: 1-[(E)-[(2Z)-3-allyl-4-chloro-2-(2-thienylsulfonylimino)-4-thiazolin-5-yl]methyleneamino]-3-methyl-thiourea Formula: C13H14ClN5O2S4 MolecularWeight: 435.99556

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NN=CC1=C(N(C(=NS(=O)(=O)C2=CC=CS2)S1)CC=C)Cl

Isomeric SMILES

CNC(=S)N/N=C/C1=C(N(/C(=N/S(=O)(=O)C2=CC=CS2)/S1)CC=C)Cl

InChI

InChI=1S/C13H14ClN5O2S4/c1-3-6-19-11(14)9(8-16-17-12(22)15-2)24-13(19)18-25(20,21)10-5-4-7-23-10/h3-5,7-8H,1,6H2,2H3,(H2,15,17,22)/b16-8+,18-13-